1-({2-[(3-bromo-4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}acetyl)piperidine-4-carboxamide
Chemical Structure Depiction of
1-({2-[(3-bromo-4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}acetyl)piperidine-4-carboxamide
1-({2-[(3-bromo-4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}acetyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | K788-5919 |
| Compound Name: | 1-({2-[(3-bromo-4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}acetyl)piperidine-4-carboxamide |
| Molecular Weight: | 514.37 |
| Molecular Formula: | C24 H24 Br N3 O5 |
| Smiles: | COc1ccc(/C=C2/C(N(CC(N3CCC(CC3)C(N)=O)=O)c3ccccc3O2)=O)cc1[Br] |
| Stereo: | ACHIRAL |
| logP: | 2.0834 |
| logD: | 2.0834 |
| logSw: | -2.8248 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.115 |
| InChI Key: | OETJGMUAVVXRAO-UHFFFAOYSA-N |